13985-60-9

Basic information

• Product Name: 2-ethyl-1,3,5-trinitrobenzene
• Synonyms: 2-ethyl-1,3,5-trinitrobenzene;trinitroethylbenzene
• CAS NO: 13985-60-9
• Molecular Formula: C₈H₇N₃O₆
• Molecular Weight: 241.15768
• EINECS: 237-778-8
• Mol File: 13985-60-9.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 337.6°C at 760 mmHg
• Flash Point: 159.3°C
• Appearance: /
• Density: 1.528g/cm³
• Vapor Pressure: 0.000203mmHg at 25°C
• Refractive Index: 1.62
• CAS DataBase Reference: 2-ethyl-1,3,5-trinitrobenzene(CAS DataBase Reference)
• NIST Chemistry Reference: 2-ethyl-1,3,5-trinitrobenzene(13985-60-9)
• EPA Substance Registry System: 2-ethyl-1,3,5-trinitrobenzene(13985-60-9)

Safety Data

• RIDADR: 0473
• HazardClass: 1.1A
• Hazardous Substances Data: 13985-60-9(Hazardous Substances Data)

Usage

InChI:InChI=1/C8H7N3O6/c1-2-6-7(10(14)15)3-5(9(12)13)4-8(6)11(16)17/h3-4H,2H2,1H3

Upstream product

• 100-41-4 ethylbenzene 
• 1204-29-1 1-ethyl-2,4-dinitrobenzene 

Downstream Products

• 603-12-3 2,6-dinitrobenzoic acid 
• 702642-41-9 2-(2,6-dinitrophenyl)propan-1-ol 
• 702642-37-3 2-(2-iodo-6-nitrophenyl)propan-1-ol 
• 702642-35-1 2-(2-bromo-6-nitrophenyl)propan-1-ol 
• 702642-19-1 2-ethyl-1-iodo-3-nitrobenzene 
• 189216-59-9 5'-O-[2-(o-nitrophenyl)prop-1-yloxycarbonyl]thymidine 
• 298699-71-5 3'-O-{[2-(2-nitrophenyl)propoxy]carbonyl}thymidine 
• 179691-31-7 2-(2-nitrophenyl)propyl chloroformate 
• 64987-77-5 2-(2-nitrophenyl)propanol 
• 702642-17-9 1-bromo-2-ethyl-3-nitrobenzene 
• 90007-09-3 2-ethyl-3-nitrobenzeneamine 

Relevant articles and documents

KINETICS AND MECHANISM OF THE REACTION OF 2,4,6-TRINITROETHYLBENZENE WITH STRONG AMINES IN POLAR APROTIC SOLVENTS

The reactions of 2,4,6-trinitroethylbenzene (TNEB) with diethylamine (DEA) in N,N-dimethylformamide (DMF) solvent and 1,1',3,3'-tetramethylguanidine (TMG) in dimethyl sulfoxide (DMSO) solvents have been studied with respect to products and kinetics.The proton transfer reaction was observed with insignificant ?-complex formation.The equilibrium constants are large, K=2717 and 497 dm3mol-1 for the reaction of TMG and DEA, respectively.The rate constants are small, kH25=1.3*10-2 and 1.5*10-2 dm3mol-1s-1 for the reaction with TMG and DEA, respectively, and these reactions show large primary deuterium kinetic isotope effects kH/kD=9.1 and 10.The rate constants, activation parameters and primary deuterium kinetic isotope effects are compared to those for proton transfer from trinitrocumene TNC, and trinitroethylbenzene TNEB to tetyramethylguanidine in DMF solvent.